[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone

Systemtic Name: [4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone Openeye Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone CAS Name: [4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-(2,3-dimethoxyphenyl)methanone IUPAC Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone Traditional Name: [4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-(2,3-dimethoxyphenyl)methanone Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

COC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C22H25N5O3/c1-29-18-9-5-7-16(20(18)30-2)22(28)27-12-10-26(11-13-27)14-19-24-17-8-4-3-6-15(17)21(23)25-19/h3-9H,10-14H2,1-2H3,(H2,23,24,25)